4-chloranyl-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxo-ethyl]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-chloro-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-chloro-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-keto-ethyl]-3-nitro-N-phenyl-benzenesulfonamide Formula: C21H18ClN3O5S2 MolecularWeight: 491.96772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)C(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1SC=C2)C(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN3O5S2/c22-18-7-6-17(12-19(18)25(27)28)32(29,30)24(16-4-2-1-3-5-16)14-21(26)23-10-8-20-15(13-23)9-11-31-20/h1-7,9,11-12H,8,10,13-14H2